1-[2-[2-(4-methylphenyl)sulfonyl-1,2,3,4-tetrazol-5-yl]ethyl]benzotriazole

Systemtic Name: 1-[2-[2-(4-methylphenyl)sulfonyl-1,2,3,4-tetrazol-5-yl]ethyl]benzotriazole Openeye Name: 1-[2-[2-(p-tolylsulfonyl)tetrazol-5-yl]ethyl]benzotriazole CAS Name: 1-[2-[2-(4-methylphenyl)sulfonyl-5-tetrazolyl]ethyl]benzotriazole IUPAC Name: 1-[2-[2-(4-methylphenyl)sulfonyltetrazol-5-yl]ethyl]benzotriazole Traditional Name: 1-[2-(2-tosyltetrazol-5-yl)ethyl]benzotriazole Formula: C16H15N7O2S MolecularWeight: 369.401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2N=C(N=N2)CCN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2N=C(N=N2)CCN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H15N7O2S/c1-12-6-8-13(9-7-12)26(24,25)23-19-16(18-21-23)10-11-22-15-5-3-2-4-14(15)17-20-22/h2-9H,10-11H2,1H3